Zurück
HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 99990Erstellt: 3. November 2026

methyl 4-[5-(4,5-dihydroxy-6-methyloxan-2-yl)oxy-4-(dimethylamino)-6-methyloxan-2-yl]oxy-2-ethyl-2,5,7,10-tetrahydroxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate

collinemycin · 1-Naphthacenecarboxylic acid, 2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7,10-tetrahydroxy-6,11-dioxo-4-[[2,3,6-trideoxy-4-O-(2,6-dideoxy-α-L-lyxo-hexopyranosyl)-3-(dimethylamino)-α-L-lyxo-hexopyranosyl]oxy]-, methyl ester, (1S,2R,4S)-

https://huagongshe.com/de/chemical/99990

Molekülstruktur von methyl 4-[5-(4,5-dihydroxy-6-methyloxan-2-yl)oxy-4-(dimethylamino)-6-methyloxan-2-yl]oxy-2-ethyl-2,5,7,10-tetrahydroxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate

Identifikatoren & physikalische Daten

CAS No.72598-49-3
SummenformelC36H45NO14
Durchschnittliche Molmasse715,7 g/mol
Monoisotopische Masse715,28400511 g/mol
SMILESCCC1(O)CC(OC2CC(N(C)C)C(OC3CC(O)C(O)C(C)O3)C(C)O2)c2c(cc3c(c2O)C(=O)c2c(O)ccc(O)c2C3=O)C1C(=O)OC
InChIKeyPXKJRTZJMGPOGS-UHFFFAOYSA-N
PubChem CID99990

Chemische & physikalische Eigenschaften

XLogP3,1
Polarare Oberfläche (TPSA)222
H-Brücken-Donoren6
H-Brücken-Akzeptoren15
Frei drehbare Bindungen8
Schwere Atome51
Formalladung0
Komplexität1.300
Siedepunkt843.239±65.00 °C(Press: 760.00 Torr)(predicted)
Dichte1.501±0.10 g/cm3(Temp: 25 °CPress: 760 Torr)(predicted)
pKa (Säurekonstante)6.205±0.70(predicted)